1. 40-0016
Fe2Pb{P2O7}2
Triklin
Dexp Dcal d(D) h k l
7.8600 7.8735 -.0135 1 0 0
6.8400 6.8358 .0042 1 1 0
4.5900 4.5925 -.0025 1 0 1
4.4400 4.4398 .0002 0 -1 1
4.0400 4.0370 .0030 0 2 0
3.9300 3.9294 .0006 1 -1 1
3.8100 3.8081 .0019 -1 -1 1
3.4100 3.4179 -.0079 2 2 0
3.2100 3.2133 -.0033 -1 -2 1
3.1600 3.1622 -.0022 -2 1 0
3.0900 3.0898 .0002 1 2 1
3.0000 3.0006 -.0006 2 -1 1
A= 8.468 DA= .008
B= 8.56 DB= .01
C= 4.949 DC= .001
GAMMA= 72.81 DGAMMA= .09
BETA = 78.93 DBETA = .01
ALPHA= 95.14 DALPHA= .02
V= 332.1
2. 40-0018
K3Fe3{PO4}4
Rombik
Groupa 31,59
Dexp. Dcal. d(D) h k l
6.9200 6.9047 .0153 1 0 1
4.6800 4.6995 -.0195 0 2 0
4.3600 4.3637 -.0037 1 0 2
3.9600 3.9579 .0021 1 1 2
3.8800 3.8850 -.0050 1 2 1
3.4600 3.4524 .0076 2 0 2
3.3900 3.3879 .0021 2 2 0
3.2000 3.2003 -.0003 2 2 1
3.0700 3.0723 -.0023 0 1 3
2.9860 2.9835 .0025 1 3 0
2.7080 2.7070 .0010 2 0 3
2.6390 2.6377 .0013 2 3 0
a= 9.78 b= 9.399 c= 9.753
da= .01 db= .009 dc= .004
V= 896
Triklin
Dexp Dcal d(D) h k l
6.9200 6.9258 -.0058 0 1 1
4.6800 4.6820 -.0020 1 1 0
4.3600 4.3595 .0005 0 -1 1
3.9600 3.9578 .0022 -1 2 0
3.8800 3.8800 -.0000 -1 1 2
3.4600 3.4629 -.0029 0 2 2
3.3900 3.3874 .0026 -2 0 1
3.2000 3.1983 .0017 1 2 1
3.0700 3.0713 -.0013 1 2 0
2.9860 2.9859 .0001 2 -1 1
2.7080 2.7078 .0002 -1 3 0
A= 7.982 DA= .001
B= 9.304 DB= .001
C= 8.095 DC= .003
GAMMA=112.231 DGAMMA= .003
BETA =104.778 DBETA = .006
ALPHA= 60.97 DALPHA= .02
V= 484.7
3. 40-0019
Na8Fe4{PO4}6
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
7.1100 7.1108 -.0008 1 1 1
6.2000 6.2000 .0000 2 0 1
4.3900 4.3895 .0005 2 2 1
3.7400 3.7385 .0015 1 3 1
3.6200 3.6177 .0023 3 2 0
3.1000 3.1000 .0000 4 0 2
2.8360 2.8350 .0010 -1 0 3
2.7800 2.7782 .0018 2 4 1
2.5940 2.5951 -.0011 -3 2 2
2.5240 2.5257 -.0017 2 4 2
2.2010 2.2010 .0000 1 5 2
2.0900 2.0899 .0001 -5 0 2
a= 13.798 b= 12.431 c= 9.507 beta=75.30
da=.006 db=.004 dc=.001 dbeta=.02
V= 1577
Triklin
Dexp Dcal d(D) h k l
7.1100 7.1118 -.0018 -1 1 1
6.2000 6.2006 -.0006 -1 1 0
4.3900 4.3903 -.0003 -1 -1 1
3.7400 3.7402 -.0002 -2 1 0
3.6200 3.6216 -.0016 -2 0 2
3.1000 3.1003 -.0003 -2 2 0
2.8360 2.8360 .0000 -3 1 1
2.7800 2.7810 -.0010 -3 2 2
2.5940 2.5941 -.0001 0 -1 3
2.5240 2.5253 -.0013 0 3 2
2.2010 2.2010 .0000 3 1 0
2.0900 2.0904 -.0004 -2 1 5
A= 8.7225 DA= .0007
B= 8.6650 DB= .0009
C= 10.594 DC= .001
GAMMA=112.99 DGAMMA= .01
BETA =118.270 DBETA = .009
ALPHA= 67.173 DALPHA= .003
V= 628.6
4. 40-0031
MgFeBO4
Triklin
Dexp Dcal d(D) h k l
8.1000 8.1066 -.0066 0 1 1
7.1000 7.0842 .0158 -1 0 1
6.6000 6.6013 -.0013 0 -1 1
6.1000 6.1056 -.0056 0 1 2
5.8000 5.8014 -.0014 1 0 1
5.5000 5.5020 -.0020 -1 1 1
4.4000 4.4107 -.0107 -1 0 3
4.2000 4.1966 .0034 -1 1 3
3.8200 3.8184 .0016 0 -2 1
3.6600 3.6567 .0033 1 -1 2
2.9690 2.9684 .0006 -1 2 4
2.5760 2.5764 -.0004 2 1 3
A= 7.3576 DA= .0003
B= 8.7105 DB= .0008
C= 14.691 DC= .002
GAMMA= 87.78 DGAMMA= .02
BETA =103.24 DBETA = .08
ALPHA= 77.71 DALPHA= .04
V=891.9
5. 40-0069
FeH4P2O8
Triklin
Dexp Dcal d(D) h k l
7.7620 7.7311 .0309 1 0 0
7.4370 7.4666 -.0296 0 1 0
3.9510 3.9578 -.0068 0 -1 1
3.8420 3.8380 .0040 1 1 1
3.6700 3.6754 -.0054 -2 1 0
3.6040 3.5888 .0152 1 -2 0
3.5830 3.5888 -.0058 -1 2 0
3.4270 3.4243 .0027 -1 -1 1
3.3380 3.3439 -.0059 0 2 1
3.1740 3.1732 .0008 1 2 0
2.8050 2.8054 -.0004 0 -2 1
2.6260 2.6251 .0009 0 1 2
A= 7.835 DA= .001
B= 7.697 DB= .009
C= 5.330 DC= .001
GAMMA= 99.32 DGAMMA= .09
BETA = 92.55 DBETA = .05
ALPHA= 79.15 DALPHA= .04
V= 311.5
6. 40-0110
CsFeP2O7
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
4.9300 4.9293 .0007 1 1 1
3.9900 3.9863 .0037 0 2 0
3.7000 3.6987 .0013 3 1 0
3.4700 3.4690 .0010 3 1 1
3.1200 3.1167 .0033 2 2 1
3.0500 3.0506 -.0006 4 0 1
3.0100 3.0117 -.0017 -3 1 1
2.0200 2.0195 .0005 6 1 0
2.6700 2.6703 -.0003 3 1 2
2.5500 2.5513 -.0013 -2 1 2
2.4600 2.4606 -.0006 0 3 1
2.3900 2.3899 .0001 5 1 0
a= 12.744 b= 7.973 c=6.6268 beta= 79.35
da=.004 db=.008 dc=.0007 dbeta=.04
V= 661.7
Triklin
Dexp Dcal d(D) h k l
4.9300 4.9185 .0115 0 0 1
3.9900 3.9900 .0000 0 -2 1
3.7000 3.6997 .0003 2 -1 1
3.4700 3.4645 .0055 2 -2 1
3.1200 3.1183 .0017 1 2 1
3.0500 3.0481 .0019 -2 -1 1
3.0100 3.0117 -.0017 2 -3 1
2.6700 2.6704 -.0004 -3 3 0
2.5500 2.5493 .0007 2 -4 1
2.4600 2.4593 .0007 0 0 2
2.3900 2.3909 -.0009 0 -2 2
2.3100 2.3126 -.0026 2 -2 2
A= 9.596 DA= .001
B= 11.436 DB= .003
C= 5.03046 DC= .00072
GAMMA=104.0990 DGAMMA= .0006
BETA = 82.11 DBETA = .05
ALPHA=100.798 DALPHA= .006
V=522.6
7. 40-0434
Na2FeO3
Triklin
Dexp Dcal d(D) h k l
5.3900 5.3866 .0034 -1 0 1
4.7500 4.7517 -.0017 0 1 1
4.4500 4.4519 -.0019 0 -1 1
3.4430 3.4426 .0004 1 1 1
3.0280 3.0302 -.0022 1 -2 1
2.6780 2.6797 -.0017 -3 0 1
2.6370 2.6372 -.0002 1 2 1
2.5280 2.5259 .0021 2 1 1
2.1970 2.1976 -.0006 -4 2 1
2.0940 2.0945 -.0005 2 2 1
1.9560 1.9560 .0000 3 1 1
1.8170 1.8171 -.0001 -2 -3 1
A= 8.8967 DA= .0005
B= 8.3813 DB= .0003
C= 6.0601 DC= .0001
GAMMA=113.08 DGAMMA= .01
BETA =108.673 DBETA = .009
ALPHA= 79.368 DALPHA= .001
V= 393.0
40-0522
CeFe{CN}6
Rombik
Groupa 17
Dexp. Dcal. d(D) h k l
5.9060 5.9005 .0055 1 0 1
4.7450 4.7516 -.0066 2 0 1
3.7620 3.7585 .0035 0 1 0
3.4730 3.4702 .0028 4 0 0
2.9450 2.9478 -.0028 2 1 1
2.6630 2.6628 .0002 3 1 1
2.5490 2.5496 -.0006 4 1 0
2.4230 2.4246 -.0016 1 1 2
2.3120 2.3135 -.0015 6 0 0
2.1130 2.1125 .0005 5 1 1
1.8430 1.8422 .0008 5 1 2
a=13.8808 b= 3.7585 c= 6.519
da= .0005 db= .0002 dc= .009
V= 340.1
8. 40-0523
GdFe{CN}6
Rombik
Groupa 32,55
Dexp. Dcal. d(D) h k l
5.8290 5.8235 .0055 1 1 0
4.6930 4.6876 .0054 2 1 0
3.7230 3.7213 .0017 3 1 0
3.4270 3.4210 .0060 4 0 0
2.9120 2.9117 .0003 2 2 0
2.6330 2.6321 .0009 4 1 2
2.5180 2.5185 -.0005 5 1 0
2.3920 2.3921 -.0001 0 2 3
2.2890 2.2898 -.0008 4 2 1
2.2300 2.2308 -.0008 6 0 1
2.0850 2.0847 .0003 5 2 0
1.8590 1.8590 .0000 3 1 5
a=13.684 b= 6.435 c=10.72971
da= .005 db= .001 dc= .00005
V= 944.9
9. 40-0524
TbFe{CN}6
Rombik
Groupa 33,49,62
Dexp. Dcal. d(D) h k l
5.8090 5.7949 .0141 1 1 0
4.6830 4.6707 .0123 1 2 0
3.7150 3.7111 .0039 1 3 0
3.4210 3.4168 .0042 0 4 0
2.9120 2.8974 .0146 2 2 0
2.7450 2.7460 -.0010 2 1 1
2.6150 2.6182 -.0032 2 3 0
2.5120 2.5137 -.0017 1 5 0
2.3890 2.3874 .0016 2 3 1
2.2870 2.2891 -.0021 1 3 2
2.0800 2.0782 .0018 2 5 0
1.8550 1.8556 -.0006 2 6 0
a= 6.398 b=13.667 c= 5.8163
da= .003 db= .008 dc= .0004
V= 508.6
10. 40-0525
DyFe{CN}6
Rombik
Groupa 29,57
Dexp. Dcal. d(D) h k l
5.8290 5.8093 .0197 1 1 0
4.6950 4.6721 .0229 2 1 0
3.7150 3.7067 .0083 3 1 0
2.9080 2.9047 .0033 2 2 0
2.6180 2.6217 -.0037 3 2 0
2.5080 2.5072 .0008 5 1 0
2.3860 2.3878 -.0018 1 2 1
2.2870 2.2847 .0023 2 2 1
2.0760 2.0771 -.0011 5 2 0
1.8500 1.8500 -.0000 0 0 2
a=13.616 b= 6.42 c= 3.7001
da= .009 db= .01 dc= .0005
V= 323.6
11. 40-0526
HoFe{CN}5
Rombik
Groupa 31,59
Dexp. Dcal. d(D) h k l
5.8100 5.8126 -.0026 1 0 1
4.6710 4.6716 -.0006 1 0 2
3.7080 3.7046 .0034 1 0 3
2.8940 2.8937 .0003 1 1 2
2.6140 2.6130 .0010 1 1 3
2.5050 2.5048 .0002 1 0 5
2.3830 2.3852 -.0022 2 1 1
2.2840 2.2822 .0018 2 1 2
2.0710 2.0717 -.0007 1 1 5
1.8430 1.8430 .0000 0 2 0
a= 6.430 b= 3.6860 c=13.598
da= .003 db= .0001 dc= .006
V= 322.2
12. 40-527
ErFe{CN}6
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
5.7910 5.7901 .0009 1 1 0
4.6710 4.6702 .0008 0 0 2
3.6930 3.6956 -.0026 2 0 1
3.3950 3.3965 -.0015 2 1 1
2.8890 2.8895 -.0005 -1 2 2
2.6070 2.6069 .0001 1 3 1
2.4960 2.4941 .0019 3 1 0
2.3710 2.3718 -.0008 -3 1 1
2.2750 2.2751 -.0001 -2 1 3
2.2300 2.2297 .0003 3 2 0
2.0670 2.0671 -.0001 2 0 4
1.8430 1.8437 -.0007 -4 1 1
a= 7.8349 b= 8.6183 c= 9.362 beta=86.117
da=.0003 db= .0004 dc= .001 dbeta=.004
V= 630.7
13. 40-0528
TmFe{CN}6
Rombik
Groupa 31,59
Dexp. Dcal. d(D) h k l
5.7720 5.7588 .0132 1 0 1
4.6460 4.6328 .0132 2 0 1
3.6850 3.6928 -.0078 1 1 1
2.6000 2.5993 .0007 3 0 2
2.4880 2.4871 .0009 5 0 1
2.3680 2.3690 -.0010 1 2 0
2.2680 2.2667 .0013 2 2 0
2.0600 2.0598 .0002 5 0 2
1.8380 1.8381 -.0001 6 0 2
a=13.508890 b= 4.8125 c= 6.366
da= .000001 db= .0004 dc= .002
v= 413.9
14. 40-0529
YbFe{CN}6
Tetragon
Groupa 105,112,131
Dexp. Dcal. d(D) h k l
5.7720 5.7686 .0034 0 0 1
4.6460 4.6377 .0083 1 1 1
3.6850 3.6761 .0089 3 0 0
2.6000 2.5994 .0006 3 3 0
2.4880 2.4876 .0004 4 0 1
2.3680 2.3699 -.0019 3 3 1
2.2680 2.2675 .0005 4 2 1
2.0600 2.0602 -.0002 5 0 1
1.8380 1.8381 -.0001 6 0 0
a= 11.028 c= 5.767
da= .006 dc= .007
v= 701.61
Rombik
Groupa 34,58
Dexp. Dcal. d(D) h k l
5.7720 5.7647 .0073 1 1 0
4.6470 4.6388 .0082 1 2 0
3.6850 3.6817 .0033 1 3 0
3.3890 3.3833 .0057 0 4 0
2.5960 2.5928 .0032 1 3 1
2.4880 2.4912 -.0032 1 5 0
2.3620 2.3638 -.0018 2 1 1
2.2620 2.2626 -.0006 2 2 1
2.0580 2.0580 .0000 1 5 1
1.9220 1.9216 .0004 3 3 0
1.8360 1.8360 .0000 3 0 1
a= 6.372 b=13.533 c= 3.652
da= .006 db= .007 dc= .003
V= 314.9
15. 40-0530
LuFe{CN}6
Monoklin
GRUPA 7,13
Dexp. Dcal. d(D) h k l
5.7350 5.7371 -.0021 0 1 1
4.6230 4.6258 -.0028 -2 1 1
3.6700 3.6704 -.0004 -2 0 2
2.5890 2.5905 -.0015 -4 1 2
2.4810 2.4808 .0002 -2 1 3
2.3620 2.3637 -.0017 -1 3 2
2.2540 2.2548 -.0008 5 1 0
2.2240 2.2240 .0000 -5 1 2
2.0530 2.0530 .0000 1 2 3
a= 12.16 b= 8.895 c=7.835 beta=106.64
da= .03 db= .004 dc=.001 dbet=.07
V=811.4
16. 40-0531
Ce4{Fe{CN}6}3
Rombik
Groupa 31,59
Dexp. Dcal. d(D) h k l
5.6090 5.6310 -.0220 1 1 0
4.5750 4.5572 .0178 1 2 0
3.6120 3.6311 -.0191 1 3 0
2.8490 2.8523 -.0033 1 3 1
2.5740 2.5729 .0011 2 0 1
2.4880 2.4870 .0010 1 4 1
2.3210 2.3217 -.0007 0 5 1
2.2410 2.2396 .0014 0 6 0
2.1600 2.1603 -.0003 1 0 2
1.8500 1.8497 .0003 2 0 2
a= 6.202 b=13.44 c= 4.6093
da= .001 db= .01 dc= .0008
v= 384.1
17. 40-0532
Pr{Fe{CN}6}3
Rombik
Groupa 30,53
Dexp. Dcal. d(D) h k l
5.7720 5.7952 -.0232 0 2 0
4.6710 4.6294 .0416 1 2 0
3.6630 3.6519 .0111 2 1 0
2.6070 2.6072 -.0002 1 0 2
2.5080 2.5047 .0033 3 1 0
2.3410 2.3457 -.0047 3 2 0
2.2490 2.2487 .0003 2 0 2
2.1610 2.1612 -.0002 1 3 2
a= 7.69 b=11.590 c= 5.542
da= .01 db= .006 dc= .001
V= 494.3
18. 40-0533
Nd4{Fe{CN}6}3
Rombik
Groupa 29,57
Dexp. Dcal. d(D) h k l
5.8100 5.8830 -.0730 0 0 2
4.6950 4.7341 -.0391 0 1 0
3.6780 3.6882 -.0102 0 1 2
2.6110 2.6063 .0047 1 1 3
2.5180 2.5194 -.0014 2 0 1
2.3680 2.3670 .0010 0 2 0
2.2650 2.2649 .0001 2 1 0
a= 5.158 b= 4.734 c=11.77
da= .002 db= .005 dc= .09
V= 287
19. 40-0534
Sm4{Fe{CN}6}3
Rombik
Groupa 29,57
Dexp. Dcal. d(D) h k l
5.7720 5.7803 -.0083 1 1 0
4.6710 4.7259 -.0549 2 0 0
3.6630 3.6529 .0101 0 2 0
2.8850 2.8902 -.0052 2 2 0
2.6000 2.5955 .0045 0 1 2
2.5010 2.5028 -.0018 1 1 2
2.3590 2.3582 .0008 1 3 0
2.2540 2.2483 .0057 4 1 0
2.1510 2.1524 -.0014 1 2 2
a= 9.45 b= 7.306 c= 5.5532
da= .02 db= .002 dc= .0008
V= 383
20. 40-0535
Eu{Fe{CN}6}3
Rombik
Groupa 19
Dexp. Dcal. d(D) h k l
5.7720 5.8162 -.0442 2 0 0
4.6590 4.6447 .0143 2 0 1
3.6700 3.6622 .0078 1 0 2
2.5960 2.6017 -.0057 0 2 1
2.4980 2.4961 .0019 2 2 0
2.3500 2.3525 -.0025 2 0 3
2.2490 2.2504 -.0014 3 2 0
2.1440 2.1443 -.0003 5 1 0
a=11.63 b= 5.527 c= 7.717
da= .03 db= .007 dc= .009
v= 496
Rombik
Groupa 33,49,62
Dexp. Dcal. d(D) h k l
5.7720 5.7830 -.0110 2 0 0
4.6590 4.6324 .0266 2 1 0
3.6700 3.6694 .0006 1 2 0
2.5960 2.5986 -.0026 4 0 1
2.4980 2.4960 .0020 2 1 2
2.3500 2.3524 -.0024 0 2 2
2.2490 2.2479 .0011 3 1 2
2.1440 2.1439 .0001 3 3 0
a=11.57 b= 7.738 c= 5.9257
da= .02 db= .009 dc= .0009
v= 530.4
21. 40-0536
G{Fe{CN}6}3
Rombik
Groupa 52
Dexp. Dcal. d(D) h k l
5.7910 5.7902 .0008 2 0 0
4.6710 4.7111 -.0401 0 1 1
3.6700 3.6543 .0157 2 1 1
2.6000 2.6024 -.0024 4 1 0
2.4980 2.5006 -.0026 2 2 1
2.3560 2.3555 .0005 0 2 2
2.2540 2.2519 .0021 3 2 1
2.1440 2.1441 -.0001 3 0 3
a=11.58 b= 5.940 c= 7.735
da= .04 db= .008 dc= .005
V= 532
22. 40-0537
Tb4{Fe{CN}6}3
Rombik
Groupa 58
Dexp. Dcal. d(D) h k l
5.7540 5.7376 .0164 1 1 0
4.6470 4.6246 .0224 1 2 0
3.6700 3.6746 -.0046 1 3 0
2.8670 2.8688 -.0018 2 2 0
2.5850 2.5827 .0023 1 4 1
2.4850 2.4890 -.0040 1 5 0
2.3500 2.3509 -.0009 1 1 2
2.2430 2.2413 .0017 1 5 1
2.0580 2.0577 .0003 2 5 0
a= 6.34 b=13.53 c= 5.15
da= .02 db= .03 dc= .01
V= 442
23. 40-0538
Dy4{Fe{CN}6}3
Rombik
Groupa 33,49,62
Dexp. Dcal. d(D) h k l
5.7350 5.7210 .0140 1 1 0
4.6230 4.6077 .0153 1 2 0
3.6480 3.6420 .0060 0 1 1
2.8580 2.8605 -.0025 2 2 0
2.5850 2.5838 .0012 2 3 0
2.4780 2.4774 .0006 1 5 0
2.3350 2.3366 -.0016 1 4 1
a= 6.32 b=13.46 c= 3.783
da= .02 db= .04 dc= .006
V=322
24. 40-0539
Ho{Fe{CN}6}3
Rombik
Groupa 17
Dexp. Dcal. d(D) h k l
5.7350 5.7546 -.0196 0 1 0
4.6350 4.6366 -.0016 0 1 1
3.6480 3.6356 .0124 2 1 1
2.6980 2.7006 -.0026 0 2 1
2.5810 2.5826 -.0016 2 2 0
2.4780 2.4763 .0017 4 1 1
2.3440 2.3451 -.0011 4 0 2
2.2430 2.2448 -.0018 5 0 1
2.1700 2.1702 -.0002 5 1 0
2.0540 2.0526 .0014 4 2 0
a=11.72 b= 5.755 c= 7.828
da= .01 db= .006 dc= .005
v= 528
25. 40-0540
Er4{Fe{CN}6}3
Rombik
Groupa 36,40,63
Dexp. Dcal. d(D) h k l
5.7350 5.7068 .0282 1 2 0
4.6230 4.6017 .0213 2 2 0
3.6480 3.6574 -.0094 3 2 0
2.8490 2.8534 -.0044 2 4 0
2.5780 2.5789 -.0009 3 4 0
2.4750 2.4779 -.0029 5 2 0
2.3410 2.3412 -.0002 0 5 1
2.2330 2.2329 .0001 0 4 2
2.0490 2.0478 .0012 5 4 0
a=13.48 b=12.599 c= 6.332
da= .02 db= .002 dc= .007
V=1075
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
5.7350 5.7321 .0029 1 1 0
4.6230 4.6257 -.0027 2 0 0
3.6480 3.6514 -.0034 0 2 0
2.8490 2.8487 .0003 1 1 1
2.5780 2.5787 -.0007 2 1 1
2.4750 2.4754 -.0004 -2 0 1
2.3410 2.3430 -.0020 3 0 1
2.2330 2.2310 .0020 3 1 1
2.0490 2.0489 .0001 -2 2 1
a= 9.313 b= 7.302860 c= 3.1726 beta= 83.39
da= .008 db= .001 dc= .0002 dbeta=.01
V= 214.3
26. 40-0541
Tm4{Fe{CN}6}3
Rombik
Groupa 33,49,62
Dexp. Dcal. d(D) h k l
5.7350 5.7071 .0279 1 1 0
4.6230 4.6007 .0223 2 1 0
3.6480 3.6560 -.0080 3 1 0
2.8490 2.8535 -.0045 2 2 0
2.5780 2.5787 -.0007 3 2 0
2.4750 2.4766 -.0016 5 1 0
2.3410 2.3361 .0049 1 2 1
2.2330 2.2373 -.0043 2 2 1
2.0490 2.0472 .0018 5 2 0
a=13.47 b= 6.30 c= 3.60
da= .01 db= .02 dc= .02
V= 305
Monoklin
GRUPA 3
Dexp. Dcal. d(D) h k l
5.7350 5.7340 .0010 1 1 0
4.6230 4.6330 -.0100 2 0 0
3.6480 3.6497 -.0017 0 2 0
2.8490 2.8490 .0000 1 1 1
2.5780 2.5800 -.0020 2 1 1
2.4750 2.4760 -.0010 -2 0 1
2.3410 2.3448 -.0038 -2 1 1
2.2330 2.2330 .0000 3 1 1
2.0490 2.0490 .0000 -2 2 1
a= 9.33 b= 7.299390 c= 3.172530 beta= 83.36
da= .01 db=.008 dc=.0002 dbet=.03
V=214.3
27. 40-0542
Yb4{Fe{CN}6}3
Monoklin
GRUPA 3
Dexp. Dcal. d(D) h k l
5.7170 5.7205 -.0035 1 1 0
4.5990 4.5979 .0011 2 0 1
2.8400 2.8408 -.0008 1 2 1
2.5640 2.5640 .0000 -2 1 2
2.4580 2.4583 -.0003 -3 0 2
2.3270 2.3267 .0003 -3 2 1
2.2300 2.2304 -.0004 -5 0 1
2.0360 2.0360 .0000 2 3 0
a= 12.191 b= 6.4820 c= 6.5190 beta= 86.172
da= .004 db=.0001 dc= .0001 dbet=.001
V=513.9
28. 40-0543
Lu{Fe{CN}6}3
Rombik
Groupa 34,58
Dexp. Dcal. d(D) h k l
5.6980 5.6832 .0148 1 1 0
4.5870 4.5760 .0110 2 1 0
3.6330 3.6334 -.0004 3 1 0
2.8400 2.8416 -.0016 2 2 0
2.5670 2.5663 .0007 3 2 0
2.4580 2.4594 -.0014 5 1 0
2.3320 2.3300 .0020 1 1 2
2.2300 2.2305 -.0005 2 1 2
2.0360 2.0352 .0008 5 2 0
1.8990 1.8998 -.0008 2 2 2
a=13.365 b= 6.2793 c= 5.109
da= .001 db= .0003 dc= .002
V= 428.8
29. 40-0647
CsFeCl6*H2O
Triklin
Dexp Dcal d(D) h k l
8.7000 8.6803 .0197 1 0 0
5.8800 5.8816 -.0016 1 2 1
5.2200 5.2208 -.0008 -1 0 1
5.1100 5.1075 .0025 -1 1 1
4.6200 4.6196 .0004 -1 -1 1
4.4700 4.4665 .0035 0 0 2
4.4000 4.3939 .0061 -1 2 1
4.3400 4.3401 -.0001 2 0 0
3.9500 3.9522 -.0022 2 2 2
3.8500 3.8552 -.0052 -1 3 0
3.8100 3.8112 -.0012 -1 -2 1
3.6400 3.6369 .0031 2 2 0
A= 9.677 DA= .006
B= 13.633 DB= .001
C= 10.324 DC= .004
GAMMA= 81.64 DGAMMA= .03
BETA = 63.78 DBETA = .01
ALPHA= 72.64 DALPHA= .02
V=1167.1
30. 40-0850
Fe2Ti3O9
Triklin
Dexp Dcal d(D) h k l
4.1000 4.0981 .0019 -1 1 1
3.3800 3.3775 .0025 -1 -1 1
2.8700 2.8692 .0008 -1 2 0
2.7400 2.7403 -.0003 -2 0 1
2.4900 2.4865 .0035 0 -2 1
2.4300 2.4281 .0019 -1 0 2
2.3000 2.3011 -.0011 -1 2 2
2.2000 2.1999 .0001 -2 1 2
1.7040 1.7050 -.0010 0 -2 2
1.6950 1.6953 -.0003 1 4 0
1.6390 1.6389 .0001 -2 1 3
1.4850 1.4850 .0000 2 4 0
1.4310 1.4309 .0001 2 0 2
A= 5.601 DA= .004
B= 7.3526 DB= .0003
C= 5.0370 DC= .0003
GAMMA= 94.08 DGAMMA= .03
BETA =113.38 DBETA = .05
ALPHA= 74.83 DALPHA= .01
V= 183.6
31. 40-0918
Fe{TcO4}3*4H2O
Triklin
Dexp Dcal d(D) h k l
2.6600 2.6588 .0012 1 -1 3
2.4900 2.4897 .0003 -1 0 4
2.3700 2.3699 .0001 0 2 1
2.2900 2.2901 -.0001 0 -2 1
2.1200 2.1202 -.0002 0 -2 2
2.0400 2.0399 .0001 -1 0 5
1.5100 1.5099 .0001 1 -3 1
1.9900 1.9880 .0020 -2 2 0
1.9200 1.9201 -.0001 0 -2 3
1.8700 1.8703 -.0003 -1 -2 3
1.8300 1.8298 .0002 -2 0 5
1.7500 1.7502 -.0002 1 1 6
A= 8.202 DA= .001
B= 4.8044 DB= .0009
C= 10.9669 DC= .0008
GAMMA= 84.86 DGAMMA= .03
BETA = 83.10 DBETA = .01
ALPHA= 84.76 DALPHA= .03
V=416.1
32. 40-0919
Fe{ReO4}3*4H2O
Triklin
Dexp Dcal d(D) h k l
3.9400 3.9386 .0014 -2 0 1
3.7200 3.7192 .0008 -2 -1 1
3.5300 3.5279 .0021 0 -2 1
3.2700 3.2680 .0020 1 -2 1
3.0800 3.0800 -.0000 -3 0 1
2.9800 2.9803 -.0003 -3 -1 1
2.8900 2.8918 -.0018 0 3 0
2.7700 2.7696 .0004 -1 3 0
2.5900 2.5922 -.0022 -1 -1 2
2.4500 2.4492 .0008 -1 1 2
2.3100 2.3093 .0007 -2 1 2
2.2000 2.1998 .0002 -3 -3 1
A= 10.6987 DA= .0002
B= 8.7219 DB= .0008
C= 5.3554 DC= .0003
GAMMA= 87.761 DGAMMA= .003
BETA = 95.313 DBETA = .004
ALPHA= 95.66 DALPHA= .01
V=495.3
33. 40-0920
Fe{TcO4}3*2H2O
Triklin
Dexp Dcal d(D) h k l
3.6400 3.6441 -.0041 -1 -1 1
3.3500 3.3519 -.0019 1 -1 1
3.2000 3.2006 -.0006 2 0 2
3.0200 3.0198 .0002 1 1 3
2.8000 2.7999 .0001 -2 -1 1
2.7800 2.7820 -.0020 0 0 4
2.5800 2.5792 .0008 -1 1 3
2.3500 2.3502 -.0002 2 0 4
2.2100 2.2101 -.0001 1 0 5
2.1500 2.1503 -.0003 0 2 2
1.9600 1.9600 .0000 3 -1 1
1.8700 1.8696 .0004 1 -1 5
A= 7.307 DA= .004
B= 4.5618 DB= .0005
C= 11.32 DC= .01
GAMMA= 79.69 DGAMMA= .03
BETA = 81.18 DBETA = .07
ALPHA= 82.61 DALPHA= .02
V=365.4
34. 40-0921
Fe{ReO4}3
Triklin
Dexp Dcal d(D) h k l
4.1200 4.1201 -.0001 0 1 1
3.8800 3.8798 .0002 0 -1 1
3.6700 3.6707 -.0007 1 0 1
3.4400 3.4367 .0033 1 2 1
3.2700 3.2700 .0000 0 -2 1
3.0800 3.0770 .0030 2 1 0
2.8300 2.8352 -.0052 0 4 0
2.5900 2.5904 -.0004 2 0 1
2.4300 2.4293 .0007 -1 3 1
2.2700 2.2684 .0016 0 -4 1
2.1300 2.1304 -.0004 -2 3 0
2.0500 2.0508 -.0008 3 1 0
A= 6.214 DA= .001
B= 11.718 DB= .008
C= 4.3237 DC= .0003
GAMMA= 76.38 DGAMMA= .02
BETA = 82.41 DBETA = .02
ALPHA= 83.18 DALPHA= .01
V= 302.0
35. 40-1112
Al85{Mn0/72Fe0/28}14Si
Rombik
Groupa 33,49,62
Dexp. Dcal. d(D) h k l
3.3510 3.3379 .0131 1 1 1
2.5280 2.5276 .0004 4 0 0
2.3710 2.3591 .0119 4 1 0
2.1650 2.1650 -.0000 4 0 1
2.0640 2.0563 .0077 4 1 1
a=10.110 b= 6.571 c= 4.195
da= .001 db= .003 dc= .001
V= 278.7
36. 40-1147
Ru4Fe
Rombik
Groupa 39,67
Dexp. Dcal. d(D) h k l
2.3210 2.3197 .0013 3 0 0
2.1220 2.1210 .0010 0 0 2
2.0330 2.0289 .0041 1 0 2
1.5650 1.5653 -.0003 3 0 2
1.3340 1.3340 -.0000 3 2 2
1.1970 1.1972 -.0002 2 4 0
a= 6.959 b= 5.100 c= 4.242
da= .001 db= .001 dc= .001
V= 150.55
37. 40-1243
Al80Cr13.5Fe6.5
Tetragon
Groupa 141
Dexp. Dcal. d(D) h k l
3.8484 3.8485 -.0001 1 0 1
2.1733 2.1746 -.0013 1 1 2
2.0651 2.0653 -.0002 2 2 0
1.4977 1.4975 .0002 3 1 2
1.2789 1.2789 .0000 0 0 4
a= 5.842 c= 5.115
da= .004 dc= .002
V= 174.6
38. 40-1582
C72H56Fe2O4P2S2
Triklin
Dexp Dcal d(D) h k l
12.4850 12.4844 .0006 1 1 0
9.1367 9.1645 -.0278 0 1 1
8.4813 8.4793 .0020 0 -1 1
7.4181 7.4399 -.0218 2 1 1
6.9975 7.0013 -.0038 1 2 0
6.5587 6.5710 -.0123 2 0 1
5.8943 5.8938 .0005 -2 -1 1
5.2927 5.3002 -.0075 -1 0 2
4.9333 4.9340 -.0007 2 -1 1
4.3894 4.3854 .0040 -3 -1 1
4.2402 4.2397 .0005 0 -2 2
4.1084 4.1063 .0021 2 1 3
A= 15.970 DA= .003
B= 14.248 DB= .006
C= 12.85 DC= .01
GAMMA= 61.54 DGAMMA= .03
BETA = 75.57 DBETA = .04
ALPHA= 79.35 DALPHA= .07
V= 2482
39. 40-1586
C44H68Fe2N2O4S2
Triklin
Dexp Dcal d(D) h k l
13.1920 13.1875 .0045 0 1 1
8.7750 8.7717 .0033 0 -1 1
8.2067 8.2150 -.0083 1 1 0
7.8649 7.8636 .0013 -1 1 1
7.2074 7.2083 -.0009 0 1 2
6.5442 6.5346 .0096 -1 2 1
6.0259 6.0169 .0090 0 -2 1
5.5117 5.5121 -.0004 -1 0 2
5.0733 5.0739 -.0006 1 -2 1
4.7498 4.7519 -.0021 0 2 3
4.5637 4.5640 -.0003 2 1 0
4.3851 4.3858 -.0007 0 -2 2
A= 9.533 DA= .001
B= 17.989 DB= .007
C= 14.426 DC= .002
GAMMA= 91.38 DGAMMA= .03
BETA = 92.09 DBETA = .03
ALPHA= 66.643 DALPHA= .005
V= 2269
40. 40-1587
C44H68Fe2N2O4S2
Triklin
Dexp Dcal d(D) h k l
14.6080 14.5986 .0094 1 0 0
10.9420 10.9421 -.0001 -1 1 0
8.3066 8.3082 -.0016 -1 1 1
7.2843 7.2946 -.0103 0 2 0
6.8360 6.8374 -.0014 -2 1 0
6.1380 6.1565 -.0185 2 0 1
5.6088 5.6082 .0006 0 0 2
5.2771 5.2847 -.0076 -2 -1 1
4.7125 4.7149 -.0024 2 -2 1
4.4883 4.4866 .0017 3 0 1
4.1810 4.1825 -.0015 -2 3 1
3.8867 3.8866 .0001 3 -2 1
A= 14.689 DA= .003
B= 14.874 DB= .008
C= 11.367 DC= .007
GAMMA= 96.31 DGAMMA= .03
BETA = 90.26 DBETA = .02
ALPHA= 80.71 DALPHA= .06
V= 2436
41. 40-1704
C33H16FeN9
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
9.9300 9.8830 .0470 1 1 0
9.2900 9.2807 .0093 -1 0 1
6.8800 6.8673 .0127 1 0 1
6.6000 6.6128 -.0128 2 0 0
6.2200 6.2347 -.0147 1 1 1
6.0500 6.0424 .0076 2 1 0
4.9400 4.9415 -.0015 2 2 0
3.4500 3.4514 -.0014 -1 4 1
3.4300 3.4336 -.0036 2 0 2
3.2700 3.2696 .0004 1 4 1
3.1200 3.1174 .0026 2 2 2
a= 13.896 b= 14.872 c= 10.162 beta= 107.86
da=/009 db=/002 dc=/007 dbeta=/09
V= 1999